methyl 4-[3-[6,8-bis(chloranyl)-4-oxidanylidene-quinazolin-3-yl]-2-oxidanyl-propoxy]benzoate

Systemtic Name: methyl 4-[3-[6,8-bis(chloranyl)-4-oxidanylidene-quinazolin-3-yl]-2-oxidanyl-propoxy]benzoate Openeye Name: methyl 4-[3-(6,8-dichloro-4-oxo-quinazolin-3-yl)-2-hydroxy-propoxy]benzoate CAS Name: 4-[3-(6,8-dichloro-4-oxo-3-quinazolinyl)-2-hydroxypropoxy]benzoic acid methyl ester IUPAC Name: methyl 4-[3-(6,8-dichloro-4-oxoquinazolin-3-yl)-2-hydroxypropoxy]benzoate Traditional Name: 4-[3-(6,8-dichloro-4-keto-quinazolin-3-yl)-2-hydroxy-propoxy]benzoic acid methyl ester Formula: C19H16Cl2N2O5 MolecularWeight: 423.24674

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C1=CC=C(C=C1)OCC(CN2C=NC3=C(C=C(C=C3C2=O)Cl)Cl)O

Isomeric SMILES

COC(=O)C1=CC=C(C=C1)OCC(CN2C=NC3=C(C=C(C=C3C2=O)Cl)Cl)O

InChI

InChI=1S/C19H16Cl2N2O5/c1-27-19(26)11-2-4-14(5-3-11)28-9-13(24)8-23-10-22-17-15(18(23)25)6-12(20)7-16(17)21/h2-7,10,13,24H,8-9H2,1H3